6IBU
Apo Crh5 transglycosylase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-12-15 |
| Detector | DECTRIS PILATUS3 S 6M |
| Wavelength(s) | 0.885601 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 55.400, 74.171, 116.820 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 62.620 - 2.250 |
| R-factor | 0.19404 |
| Rwork | 0.192 |
| R-free | 0.23101 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5NDL |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.616 |
| Data reduction software | MOSFLM |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 62.620 | 2.331 |
| High resolution limit [Å] | 2.250 | 2.250 |
| Number of reflections | 23428 | 2317 |
| <I/σ(I)> | 7.99 | |
| Completeness [%] | 99.0 | 99.44 |
| Redundancy | 4.1 | 4.2 |
| CC(1/2) | 0.807 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 298 | 0.1M sodium acetate trihydrate pH 4.0, 1,6M ammonium sulphate, 21mM ZnCl2 |
